>compound Amantadine_Amantadine
#instrument UPLC Q-Tof Premier, Waters
>formula C10H17N
#smiles NC(C3)(C1)CC(C2)CC(CC23)1
#RECORD LC-ESI-QTOF_train_data/PR100106.txt;LC-ESI-QTOF_train_data/PR100105.txt
>charge 1
>ionization [M+H]+
>parentmass 152.14389

>collision 30
135.1189 56.77
152.1095 3.628
152.1439 63.4

>collision 5-60
135.1194 544.8
152.1439 3860.0

